SCHEMBL18880295

SCHEMBL18880295

CCN(CC)C(=O)CNCc1cc(/C=N/CCO)ccn1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KDM5B Q9UGL1 15/20 0.51
▸ KDM5C P41229 9/20 0.51
▸ KDM5A P29375 7/20 0.51
▸ KDM4A O75164 3/20 0.51
▸ KDM6B O15054 1/20 0.51
▸ KDM2B Q8NHM5 1/20 0.51
▸ KDM4C Q9H3R0 2/20 0.50
▸ KDM5D Q9BY66 1/20 0.50
▸ CYP2D6 P10635 2/20 0.35
▸ SLC6A2 P23975 1/20 0.33
▸ SLC6A4 P31645 1/20 0.33
▸ SLC6A3 Q01959 1/20 0.33
▸ KDM4B O94953 1/20 0.32
▸ CACNA1B Q00975 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL15996136 0.93 KDM5B (0.62) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL15996137 0.93 KDM5B (0.62) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL16292749 0.90 KDM5B (0.56) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL16305543 0.90 KDM5B (0.56) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL15994311 0.90 KDM5B (0.48) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL15994313 0.90 KDM5B (0.48) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL16305533 0.90 KDM5B (0.47) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL16293343 0.90 KDM5B (0.47) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL20041897 0.89 KDM5B (0.43) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL15994395 0.89 KDM5B (0.51) KDM5BKDM5CKDM5AKDM4AKDM6B

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3170811-A1 ETHYL PYRIDINE-4-CARBOXYLATE COMPOUND AS INHIBITOR OF HISTONE DEMETHYLASES Gilead Sciences, Inc. (US) 2017-05-24 — — EP disclosed
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